2-azanyl-4-(4-morpholin-4-ylsulfonylphenyl)-6-sulfanylidene-1H-pyridine-3,5-dicarbonitrile; 4-methylmorpholin-4-ium

Systemtic Name: 2-azanyl-4-(4-morpholin-4-ylsulfonylphenyl)-6-sulfanylidene-1H-pyridine-3,5-dicarbonitrile; 4-methylmorpholin-4-ium Openeye Name: 2-amino-4-(4-morpholinosulfonylphenyl)-6-thioxo-1H-pyridine-3,5-dicarbonitrile; 4-methylmorpholin-4-ium CAS Name: 2-amino-4-[4-(4-morpholinylsulfonyl)phenyl]-6-sulfanylidene-1H-pyridine-3,5-dicarbonitrile; 4-methylmorpholin-4-ium IUPAC Name: 2-amino-4-(4-morpholin-4-ylsulfonylphenyl)-6-sulfanylidene-1H-pyridine-3,5-dicarbonitrile; 4-methylmorpholin-4-ium Traditional Name: 2-amino-4-(4-morpholinosulfonylphenyl)-6-thioxo-1H-pyridine-3,5-dicarbonitrile; 4-methylmorpholin-4-ium Formula: C22H27N6O4S2+ MolecularWeight: 503.61758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCOCC1.C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C3=C(C(=S)NC(=C3C#N)N)C#N

Isomeric SMILES

C[NH+]1CCOCC1.C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C3=C(C(=S)NC(=C3C#N)N)C#N

InChI

InChI=1S/C17H15N5O3S2.C5H11NO/c18-9-13-15(14(10-19)17(26)21-16(13)20)11-1-3-12(4-2-11)27(23,24)22-5-7-25-8-6-22;1-6-2-4-7-5-3-6/h1-4H,5-8H2,(H3,20,21,26);2-5H2,1H3/p+1